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(9Z,12Z,15Z)-3-hydroxyoctadecatrienoylcarnitine

PropertiesImage
MNX_IDMNXM149532 Image of MNXM149532
referencechebi:73116
formulaC25H43NO5
global charge0
mol weight437.621
InChIKeyZJZLUQLCVQGASB-QNEBEIHSSA-N
InChIInChI=1S/C25H43NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(27)19-25(30)31-23(20-24(28)29)21-26(2,3)4/h6-7,9-10,12-13,22-23,27H,5,8,11,14-21H2,1-4H3/b7-6-,10-9-,13-12-
SMILESCC/C=C\C/C=C\C/C=C\CCCCCC(O)CC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C25H43NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(27)19-25(30)31-23(20-24(28)29)21-26(2,3)4/h6-7,9-10,12-13,22-23,27H,5,8,11,14-21H2,1-4H3/b7-6-,10-9-,13-12-/t22?,23? Image of MNXM149532
SMILES (mnx)[CH3:1][CH2:5]/[CH:6]=[CH:7]\[CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH:22]([CH2:19][C:25](=[O:30])[O:31][CH:23]([CH2:20][C:24](=[O:28])[O-:29])[CH2:21][N+:26]([CH3:2])([CH3:3])[CH3:4])[OH:27]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:73116
chebi:73116
ZJZLUQLCVQGASB-QNEBEIHSSA-N 		(9Z,12Z,15Z)-3-hydroxyoctadecatrienoylcarnitine
3-{[(9Z,12Z,15Z)-3-hydroxyoctadeca-9,12,15-trienoyl]oxy}-4-(trimethylammonio)butanoate
3-{[(9Z,12Z,15Z)-3-hydroxyoctadeca-9,12,15-trienoyl]oxy}-4-(trimethylazaniumyl)butanoate
9--cis,12-cis,15-cis-3-hydroxyoctadecatrienoylcarnitine
hmdb:HMDB0240763
ZJZLUQLCVQGASB-QNEBEIHSSA-N 		(9Z,12Z,15Z)-3-Hydroxyoctadecatrienoylcarnitine
3-{[(9Z,12Z,15Z)-3-hydroxyoctadeca-9,12,15-trienoyl]oxy}-4-(trimethylammonio)butanoate
3-{[(9Z,12Z,15Z)-3-hydroxyoctadeca-9,12,15-trienoyl]oxy}-4-(trimethylammonio)butanoic acid
9--cis,12-cis,15-cis-3-Hydroxyoctadecatrienoylcarnitine

lipidmaps:LMFA07070027
lipidmapsM:LMFA07070027
ZJZLUQLCVQGASB-QNEBEIHSSA-N 		(9Z,12Z,15Z)-3-hydroxyoctadecatrienoylcarnitine
3-{[(9Z,12Z,15Z)-3-hydroxyoctadeca-9,12,15-trienoyl]oxy}-4-(trimethylammonio)butanoate
3-{[(9Z,12Z,15Z)-3-hydroxyoctadeca-9,12,15-trienoyl]oxy}-4-(trimethylazaniumyl)butanoate
9--cis,12-cis,15-cis-3-hydroxyoctadecatrienoylcarnitine
CAR 18:3
O